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2-acetamido-6-aminocarbonyl-3-hexadecoxy-benzenesulfonic acid

2-acetamido-6-aminocarbonyl-3-hexadecoxy-benzenesulfonic acid

Systemtic Name:2-acetamido-6-aminocarbonyl-3-hexadecoxy-benzenesulfonic acid
Openeye Name:2-acetamido-6-carbamoyl-3-hexadecoxy-benzenesulfonic acid
CAS Name:2-acetamido-6-carbamoyl-3-hexadecoxybenzenesulfonic acid
IUPAC Name:2-acetamido-6-carbamoyl-3-hexadecoxybenzenesulfonic acid
Traditional Name:2-acetamido-6-carbamoyl-3-cetyloxy-besylic acid
Formula: C25H42N2O6S
MolecularWeight: 498.67578
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C(=C(C=C1)C(=O)N)S(=O)(=O)O)NC(=O)C


Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C(=C(C=C1)C(=O)N)S(=O)(=O)O)NC(=O)C


InChI

InChI=1S/C25H42N2O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-33-22-18-17-21(25(26)29)24(34(30,31)32)23(22)27-20(2)28/h17-18H,3-16,19H2,1-2H3,(H2,26,29)(H,27,28)(H,30,31,32)


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